Cas no 94200-93-8 (Cyclohexanepropanol,4-(1,1-dimethylpropyl)-b-methyl-)
94200-93-8 structure
Product Name:Cyclohexanepropanol,4-(1,1-dimethylpropyl)-b-methyl-
CAS No:94200-93-8
MF:C15H30O
MW:226.398105144501
CID:811842
PubChem ID:11971328
Update Time:2025-04-19
Cyclohexanepropanol,4-(1,1-dimethylpropyl)-b-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanepropanol,4-(1,1-dimethylpropyl)-b-methyl-
- 2-methyl-3-[4-(2-methylbutan-2-yl)cyclohexyl]propan-1-ol
- 4-(1,1-dimethylpropyl)-beta-methylcyclohexanepropanol
- EINECS 303-573-8
- 94200-93-8
- DTXSID60916158
- NS00065304
-
- Inchi： 1S/C15H30O/c1-5-15(3,4)14-8-6-13(7-9-14)10-12(2)11-16/h12-14,16H,5-11H2,1-4H3
- InChI Key： VUDFQMZLNWAJIS-UHFFFAOYSA-N
- SMILES： OCC(C)CC1CCC(CC1)C(C)(C)CC
Computed Properties
- Exact Mass: 226.229666
- Monoisotopic Mass: 226.229666
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 190
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 5.4
- Topological Polar Surface Area: 20.2
Experimental Properties
- Density: 0.878
- Boiling Point: 281.8°Cat760mmHg
- Flash Point: 125.4°C
- Refractive Index: 1.46
Cyclohexanepropanol,4-(1,1-dimethylpropyl)-b-methyl- Related Literature
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1. Fe3O4/Au/Fe3O4 nanoflowers exhibiting tunable saturation magnetization and enhanced bioconjugationFeng Shi,Kunping Yan,Mingli Peng,Xiao Cheng,Yanling Luo,Xuemei Chen,V. A. L. Roy,Zuankai Wang Nanoscale, 2012,4, 747-751
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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